N-[(E)-[3-bromanyl-4-[(4-cyanophenyl)methoxy]-5-methoxy-phenyl]methylideneamino]-2-naphthalen-1-ylsulfanyl-ethanamide

Systemtic Name: N-[(E)-[3-bromanyl-4-[(4-cyanophenyl)methoxy]-5-methoxy-phenyl]methylideneamino]-2-naphthalen-1-ylsulfanyl-ethanamide Openeye Name: N-[(E)-[3-bromo-4-[(4-cyanophenyl)methoxy]-5-methoxy-phenyl]methyleneamino]-2-(1-naphthylsulfanyl)acetamide CAS Name: N-[(E)-[3-bromo-4-[(4-cyanophenyl)methoxy]-5-methoxyphenyl]methylideneamino]-2-(1-naphthalenylthio)acetamide IUPAC Name: N-[(E)-[3-bromo-4-[(4-cyanophenyl)methoxy]-5-methoxyphenyl]methylideneamino]-2-naphthalen-1-ylsulfanylacetamide Traditional Name: N-[(E)-[3-bromo-4-(4-cyanobenzyl)oxy-5-methoxy-benzylidene]amino]-2-(1-naphthylthio)acetamide Formula: C28H22BrN3O3S MolecularWeight: 560.46158

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=NNC(=O)CSC2=CC=CC3=CC=CC=C32)Br)OCC4=CC=C(C=C4)C#N

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=N/NC(=O)CSC2=CC=CC3=CC=CC=C32)Br)OCC4=CC=C(C=C4)C#N

InChI

InChI=1S/C28H22BrN3O3S/c1-34-25-14-21(13-24(29)28(25)35-17-20-11-9-19(15-30)10-12-20)16-31-32-27(33)18-36-26-8-4-6-22-5-2-3-7-23(22)26/h2-14,16H,17-18H2,1H3,(H,32,33)/b31-16+